SCHEMBL582340

SCHEMBL582340

COC(=O)N1CC[C@@H](c2cc(=O)[nH]o2)C[C@H]1Cc1cc(F)ccc1F

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLG P00747 10/20 0.43
ECE1 P42892 1/20 0.36
SLC6A4 P31645 1/20 0.35
HCRTR2 O43614 1/20 0.35
DPP4 P27487 4/20 0.35
DPP8 Q6V1X1 2/20 0.35
DPP7 Q9UHL4 2/20 0.35
DPP9 Q86TI2 1/20 0.35
ATM Q13315 2/20 0.34
GPR119 Q8TDV5 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL581404 1.00 PLG (0.43) PLGECE1SLC6A4HCRTR2DPP4
SCHEMBL3068733 1.00 PLG (0.43) PLGECE1SLC6A4HCRTR2DPP4
SCHEMBL586608 1.00 PLG (0.43) PLGECE1SLC6A4HCRTR2DPP4
SCHEMBL587396 0.93 PLG (0.43) PLGHCRTR2ATM
SCHEMBL586721 0.93 PLG (0.43) PLGHCRTR2ATM
SCHEMBL582146 0.93 PLG (0.43) PLGHCRTR2ATM
SCHEMBL3075971 0.93 PLG (0.43) PLGHCRTR2ATM
SCHEMBL582475 0.90 PLG (0.56) PLGDPP4DPP8DPP7ATM
SCHEMBL581748 0.90 PLG (0.56) PLGDPP4DPP8DPP7ATM
SCHEMBL3078298 0.90 PLG (0.56) PLGDPP4DPP8DPP7ATM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8415378-B2 Isoxazol-3(2H)-one analogs as therapeutic agents ASTRAZENECA AB (SE) 2013-04-09 US disclosed
EP-2417131-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS AstraZeneca AB (SE) 2012-02-15 EP disclosed
WO-2010117323-A1 METHOD AND APPARATUS FOR PRODUCING HEAT ENERGY AND CARBON DIOXIDE ASTRAZENECA AB (SE) 2010-10-14 WO disclosed
US-20100261755-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2010-10-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100261755-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS NR4A3, CBR3, OXER1 PLG 4861/4885ECE1 3163/4885SLC6A4 64/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.